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FW3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C7S6sing1.71Å1.74ÅAromatic
C7N8doub1.28Å1.31ÅAromatic
S6C5sing1.76Å1.74ÅAromatic
N8C9sing1.35Å1.39ÅAromatic
C9C5doub1.40Å1.41ÅAromatic
C9C10sing1.41Å1.40ÅAromatic
C5C4sing1.39Å1.38ÅAromatic
C10C11doub1.36Å1.39ÅAromatic
C4C3doub1.38Å1.39ÅAromatic
C11C3sing1.39Å1.39ÅAromatic
C3S2sing1.76Å1.74Å
O35S2doub1.42Å1.43Å
S2N12sing1.66Å1.64Å
S2O1doub1.42Å1.43Å
C14C13sing1.53Å1.52Å
C14C15sing1.53Å1.52Å
C13N12sing1.47Å1.48Å
N12C34sing1.47Å1.48Å
C16C15sing1.53Å1.53Å
C16C17sing1.53Å1.52Å
C15C33sing1.53Å1.52Å
C33C34sing1.53Å1.52Å
C22C21doub1.38Å1.38ÅAromatic
C22C23sing1.39Å1.39ÅAromatic
C21C20sing1.38Å1.39ÅAromatic
C27C28doub1.38Å1.38ÅAromatic
C27C26sing1.38Å1.38ÅAromatic
C28C29sing1.38Å1.39ÅAromatic
C26C25doub1.38Å1.39ÅAromatic
N18C17sing1.47Å1.49Å
N18C19sing1.47Å1.50Å
C29C24doub1.39Å1.40ÅAromatic
C25C24sing1.39Å1.40ÅAromatic
C24C23sing1.48Å1.49Å
C23C30doub1.39Å1.41ÅAromatic
C20C19sing1.51Å1.51Å
C20C32doub1.38Å1.39ÅAromatic
C30C32sing1.38Å1.39ÅAromatic
C30CL31sing1.74Å1.74Å
C27H1sing1.08Å1.08Å
C26H2sing1.08Å1.08Å
C22H3sing1.08Å1.08Å
C19H4sing1.09Å1.10Å
C19H5sing1.09Å1.10Å
C21H6sing1.08Å1.08Å
C17H7sing1.09Å1.10Å
C17H8sing1.09Å1.10Å
C11H9sing1.08Å1.08Å
C7H10sing1.08Å1.08Å
C14H11sing1.09Å1.10Å
C14H12sing1.09Å1.10Å
C4H13sing1.08Å1.08Å
C10H14sing1.08Å1.08Å
C13H15sing1.09Å1.10Å
C13H16sing1.09Å1.10Å
C15H17sing1.09Å1.10Å
C16H18sing1.09Å1.10Å
C16H19sing1.09Å1.10Å
N18H20sing1.01Å1.00Å
C25H22sing1.08Å1.08Å
C28H23sing1.08Å1.08Å
C29H24sing1.08Å1.08Å
C32H25sing1.08Å1.08Å
C33H26sing1.09Å1.10Å
C33H27sing1.09Å1.10Å
C34H28sing1.09Å1.10Å
C34H29sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
S6C7N8117.1°111.5°
C7S6C588.5°90.8°
S6C7H10121.5°124.3°
C7N8C9109.7°117.8°
N8C7H10121.4°124.2°
S6C5C9109.9°108.0°
S6C5C4128.4°131.7°
N8C9C5114.8°111.8°
N8C9C10126.1°129.7°
C5C9C10119.1°118.5°
C9C5C4121.7°120.2°
C9C10C11119.7°120.4°
C9C10H14120.1°119.7°
C5C4C3117.9°120.0°
C5C4H13121.0°120.0°
C10C11C3119.5°120.8°
C10C11H9120.2°119.6°
C11C10H14120.1°119.8°
C4C3C11122.0°120.0°
C4C3S2117.8°119.9°
C3C4H13121.0°120.0°
C11C3S2119.4°120.0°
C3C11H9120.2°119.6°
C3S2O35108.0°106.4°
C3S2N12106.2°107.2°
C3S2O1107.4°106.4°
O35S2N12106.9°106.4°
O35S2O1120.6°123.1°
N12S2O1107.0°106.4°
S2N12C13118.6°120.6°
S2N12C34118.2°120.6°
C13C14C15112.6°109.3°
C14C13N12109.4°108.8°
C13C14H11108.7°109.5°
C13C14H12108.7°109.5°
C14C13H15109.5°109.6°
C14C13H16109.5°109.6°
C14C15C16112.3°109.5°
C14C15C33108.6°109.5°
C15C14H11108.7°109.5°
C15C14H12108.7°109.5°
C14C15H17108.2°109.5°
C13N12C34112.8°118.8°
N12C13H15109.5°109.6°
N12C13H16109.5°109.6°
N12C34C33110.6°108.8°
N12C34H28109.2°109.6°
N12C34H29109.2°109.6°
C15C16C17114.7°109.5°
C16C15C33111.2°109.4°
C16C15H17108.1°109.4°
C15C16H18108.2°109.4°
C15C16H19108.1°109.5°
C16C17N18112.4°109.5°
C16C17H7108.7°109.5°
C16C17H8108.7°109.4°
C17C16H18108.1°109.5°
C17C16H19108.2°109.5°
C15C33C34113.1°109.3°
C33C15H17108.2°109.4°
C15C33H26108.5°109.5°
C15C33H27108.6°109.5°
C34C33H26108.6°109.5°
C34C33H27108.5°109.5°
C33C34H28109.2°109.5°
C33C34H29109.2°109.6°
C21C22C23121.2°119.9°
C22C21C20121.5°120.1°
C21C22H3119.4°120.1°
C22C21H6119.2°119.9°
C22C23C24116.6°120.2°
C22C23C30117.1°119.7°
C23C22H3119.4°120.0°
C21C20C19120.4°119.9°
C21C20C32118.3°120.3°
C20C21H6119.3°120.0°
C28C27C26119.7°120.3°
C27C28C29120.4°120.1°
C28C27H1120.2°119.8°
C27C28H23119.8°120.0°
C27C26C25120.3°120.1°
C26C27H1120.1°119.9°
C27C26H2119.8°119.9°
C28C29C24120.8°119.9°
C29C28H23119.8°119.9°
C28C29H24119.6°120.0°
C26C25C24120.9°119.9°
C25C26H2119.9°120.0°
C26C25H22119.5°120.0°
C17N18C19115.4°111.0°
N18C17H7108.8°109.5°
N18C17H8108.7°109.5°
C17N18H20108.0°111.0°
N18C19C20112.0°109.4°
N18C19H4108.9°109.5°
N18C19H5108.8°109.4°
C19N18H20108.0°111.0°
C29C24C25117.8°119.7°
C29C24C23121.3°120.2°
C24C29H24119.6°120.1°
C25C24C23120.4°120.1°
C24C25H22119.6°120.1°
C24C23C30125.4°120.1°
C23C30C32121.5°119.8°
C23C30CL31121.6°120.1°
C19C20C32121.2°119.8°
C20C19H4108.8°109.5°
C20C19H5108.8°109.5°
C20C32C30120.4°120.1°
C20C32H25119.8°120.0°
C32C30CL31116.8°120.1°
C30C32H25119.8°120.0°
H4C19H5109.5°109.5°
H7C17H8109.5°109.4°
H11C14H12109.5°109.5°
H15C13H16109.5°109.7°
H18C16H19109.5°109.5°
H26C33H27109.4°109.5°
H28C34H29109.4°109.7°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
S6C7N8H10180.0°180.0°
S6C7N8C90.2°0.0°
C7S6C5C90.1°0.0°
C7S6C5C4179.9°180.0°
N8C7S6C50.2°0.0°
C7N8C9C50.1°0.0°
C7N8C9C10179.7°179.7°
S6C5C9N80.1°0.0°
S6C5C9C4180.0°180.0°
S6C5C9C10179.6°179.8°
S6C5C4C3179.3°180.0°
C5S6C7H10179.8°180.0°
S6C5C4H130.8°0.1°
N8C9C5C10179.7°179.7°
N8C9C5C4179.9°180.0°
N8C9C10C11179.9°179.9°
C9N8C7H10179.8°180.0°
N8C9C10H140.1°0.1°
C5C9C10C110.3°0.5°
C9C5C4C30.7°0.0°
C9C5C4H13179.2°179.9°
C5C9C10H14179.7°179.6°
C10C9C5C40.4°0.2°
C9C10C11H14180.0°179.9°
C9C10C11C30.6°0.5°
C9C10C11H9179.4°179.8°
C5C4C3H13180.0°179.9°
C5C4C3C111.0°0.0°
C5C4C3S2169.0°180.0°
C10C11C3C41.0°0.2°
C10C11C3H9180.0°179.7°
C10C11C3S2168.9°179.8°
C4C3C11S2169.8°180.0°
C4C3S2O3536.9°23.5°
C4C3S2N1277.5°90.0°
C4C3S2O1168.3°156.5°
C4C3C11H9179.0°180.0°
C11C3S2O35152.8°156.4°
C11C3S2N1292.8°90.0°
C11C3S2O121.4°23.5°
C11C3C4H13178.9°179.9°
C3C11C10H14179.4°179.6°
C3S2O35N12113.9°114.1°
C3S2O35O1123.8°123.0°
C3S2N12O1114.5°113.5°
C3S2N12C1396.1°90.0°
C3S2N12C34121.4°90.0°
S2C3C11H911.1°0.1°
S2C3C4H1311.1°0.0°
O35S2N12O1130.4°132.9°
O35S2N12C1319.0°156.4°
O35S2N12C34123.5°23.5°
S2N12C13C14157.8°126.4°
S2N12C13C34144.4°180.0°
S2N12C34C33159.0°126.4°
S2N12C13H1582.2°113.8°
S2N12C13H1637.8°6.6°
S2N12C34H2880.8°113.8°
S2N12C34H2938.8°6.6°
O1S2N12C13149.4°23.5°
O1S2N12C347.0°156.4°
C13C14C15H11120.5°120.0°
C13C14C15H12120.5°120.0°
C14C13N12H15120.0°119.8°
C14C13N12H16120.0°119.8°
C14C13N12C3457.8°53.6°
C13C14C15C16178.0°178.6°
C13C14C15C3354.5°61.3°
C13C14H11H12118.6°120.1°
C14C13H15H16120.0°120.3°
C13C14C15H1762.8°58.6°
C15C14C13N1257.3°54.6°
C14C15C16C33122.0°120.1°
C14C15C16H17119.3°120.0°
C14C15C16C17176.2°175.0°
C14C15C33H17117.3°120.0°
C14C15C33C3452.8°61.3°
C15C14H11H12118.6°120.0°
C15C14C13H1562.7°65.1°
C15C14C13H16177.3°174.5°
C14C15C16H1863.1°55.0°
C14C15C16H1955.4°65.0°
C14C15C33H2667.8°58.6°
C14C15C33H27173.3°178.7°
C13N12C34C3356.5°53.5°
N12C13C14H1163.2°65.4°
N12C13C14H12177.8°174.6°
N12C13H15H16120.1°120.4°
C13N12C34H2863.7°66.2°
C13N12C34H29176.6°173.3°
N12C34C33C1554.2°54.6°
N12C34C33H28120.2°119.8°
N12C34C33H29120.2°119.8°
C34N12C13H1562.1°66.2°
C34N12C13H16177.8°173.4°
N12C34C33H2666.4°65.3°
N12C34C33H27174.7°174.6°
N12C34H28H29119.5°120.4°
C15C16C17H18120.8°119.9°
C15C16C17H19120.8°120.0°
C16C15C33H17118.7°119.9°
C16C15C33C34176.8°178.6°
C15C16C17N18168.9°180.0°
C15C16C17H748.4°60.0°
C15C16C17H870.7°60.0°
C16C15C14H1157.5°61.4°
C16C15C14H1261.6°58.7°
C15C16H18H19117.6°120.0°
C16C15C33H2656.3°61.4°
C16C15C33H2762.6°58.7°
C17C16C15C3361.9°65.0°
C16C17N18H7120.4°120.1°
C16C17N18H8120.4°120.0°
C16C17N18C19154.4°180.0°
C16C17H7H8118.7°120.0°
C17C16C15H1756.9°55.0°
C17C16H18H19117.6°120.0°
C16C17N18H2033.5°56.0°
C15C33C34H26120.6°119.9°
C15C33C34H27120.6°120.0°
C33C15C14H1165.9°58.6°
C33C15C14H12175.0°178.7°
C33C15C16H1858.9°175.1°
C33C15C16H19177.3°55.1°
C15C33H26H27118.3°120.1°
C15C33C34H2866.1°65.2°
C15C33C34H29174.3°174.4°
C34C33C15H1764.5°58.7°
C34C33H26H27118.3°120.1°
C33C34H28H29119.4°120.3°
C21C22C23H3180.0°179.7°
C22C21C20H6180.0°179.9°
C21C22C23C24169.0°180.0°
C21C22C23C300.8°0.0°
C22C21C20C19179.5°180.0°
C22C21C20C320.2°0.0°
C23C22C21C200.5°0.0°
C22C23C24C2996.7°50.0°
C22C23C24C2575.1°130.0°
C22C23C24C30168.9°180.0°
C22C23C30C320.7°0.0°
C22C23C30CL31179.9°180.0°
C23C22C21H6179.4°180.0°
C21C20C19N1858.1°90.0°
C21C20C19C32179.2°180.0°
C21C20C32C300.1°0.0°
C20C21C22H3179.4°179.7°
C21C20C19H4178.5°30.0°
C21C20C19H562.2°150.1°
C21C20C32H25179.9°180.0°
C28C27C26H1180.0°179.8°
C27C28C29H23180.0°180.0°
C28C27C26C250.1°0.0°
C27C28C29C240.2°0.0°
C28C27C26H2179.9°180.0°
C27C28C29H24179.8°179.9°
C26C27C28C290.2°0.0°
C27C26C25H2180.0°180.0°
C27C26C25C240.1°0.0°
C27C26C25H22179.9°179.9°
C26C27C28H23179.9°180.0°
C28C29C24H24180.0°180.0°
C28C29C24C250.2°0.0°
C28C29C24C23171.7°180.0°
C29C28C27H1179.8°179.8°
C26C25C24C290.2°0.0°
C26C25C24H22180.0°179.9°
C26C25C24C23171.9°180.0°
C25C26C27H1179.9°179.8°
C17N18C19H20120.9°123.9°
C17N18C19C20177.1°180.0°
C17N18C19H456.7°60.0°
C17N18C19H562.5°60.0°
N18C17H7H8118.7°120.0°
N18C17C16H1870.3°60.0°
N18C17C16H1948.1°60.0°
N18C19C20H4120.4°120.0°
N18C19C20H5120.4°120.0°
N18C19C20C32122.6°90.0°
N18C19H4H5118.9°120.0°
C19N18C17H785.2°60.0°
C19N18C17H834.0°60.0°
C29C24C25C23172.0°180.0°
C29C24C23C3094.5°130.0°
C29C24C25H22179.8°180.0°
C24C29C28H23179.8°179.9°
C25C24C23C3093.7°50.0°
C24C25C26H2179.9°180.0°
C25C24C29H24179.8°179.9°
C24C23C30C32168.1°180.0°
C24C23C30CL3111.3°0.0°
C24C23C22H311.0°0.3°
C23C24C25H228.1°0.1°
C23C24C29H248.3°0.1°
C23C30C32C200.4°0.0°
C23C30C32CL31179.4°180.0°
C30C23C22H3179.2°179.7°
C23C30C32H25179.6°180.0°
C19C20C32C30179.4°180.0°
C20C19H4H5118.8°120.0°
C19C20C21H60.5°0.0°
C20C19N18H2062.0°56.1°
C19C20C32H250.6°0.0°
C20C32C30H25180.0°180.0°
C20C32C30CL31179.8°180.0°
C32C20C19H42.2°150.0°
C32C20C19H5117.0°29.9°
C32C20C21H6179.8°180.0°
CL31C30C32H250.2°0.0°
H1C27C26H20.1°0.2°
H1C27C28H230.1°0.3°
H2C26C25H220.1°0.0°
H3C22C21H60.6°0.3°
H4C19N18H20177.6°63.9°
H5C19N18H2058.3°176.0°
H7C17C16H18169.2°60.0°
H7C17C16H1972.3°180.0°
H7C17N18H20154.0°176.1°
H8C17C16H1850.1°180.0°
H8C17C16H19168.6°60.0°
H8C17N18H2086.9°63.9°
H9C11C10H140.6°0.1°
H11C14C13H15176.8°174.9°
H11C14C13H1656.8°54.5°
H11C14C15H17176.8°178.6°
H12C14C13H1557.8°54.8°
H12C14C13H1662.2°65.6°
H12C14C15H1757.7°61.3°
H17C15C16H18177.7°65.0°
H17C15C16H1963.9°175.0°
H17C15C33H26174.9°178.7°
H17C15C33H2756.1°61.3°
H23C28C29H240.2°0.1°
H26C33C34H28173.4°174.9°
H26C33C34H2953.8°54.5°
H27C33C34H2854.5°54.8°
H27C33C34H2965.1°65.6°

222415

PDB entries from 2024-07-10

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